Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.57 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.57 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.48 |
| ▸ | KCNA5 | P22460 | 2/20 | 0.46 |
| ▸ | MKNK1 | Q9BUB5 | 3/20 | 0.45 |
| ▸ | MKNK2 | Q9HBH9 | 3/20 | 0.45 |
| ▸ | MMP1 | P03956 | 1/20 | 0.44 |
| ▸ | MMP2 | P08253 | 1/20 | 0.44 |
| ▸ | MMP9 | P14780 | 1/20 | 0.44 |
| ▸ | MMP8 | P22894 | 1/20 | 0.44 |
| ▸ | MMP12 | P39900 | 1/20 | 0.44 |
| ▸ | MMP13 | P45452 | 1/20 | 0.44 |
| ▸ | MMP14 | P50281 | 1/20 | 0.44 |
| ▸ | MMP16 | P51512 | 1/20 | 0.44 |
| ▸ | KMO | O15229 | 1/20 | 0.43 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL1812320 | 0.94 | AKR1C3 (0.54) | AKR1C3AKR1C2PTGS2KCNA5MKNK1 | |
| SCHEMBL2393839 | 0.85 | PTGS2 (0.56) | AKR1C3AKR1C2PTGS2MMP1MMP2 | |
| SCHEMBL27897971 | 0.85 | SLC2A1 (0.53) | AKR1C3AKR1C2PTGS2KCNA5MKNK1 | |
| Biphenyl SCHEMBL7876282 | 0.83 | PTGS2 (0.58) | AKR1C3AKR1C2PTGS2MMP1MMP2 | |
| SCHEMBL1812323 | 0.83 | AKR1C3 (0.56) | AKR1C3AKR1C2PTGS2KCNA5MKNK1 | |
| SCHEMBL2737367 | 0.82 | USP1 (0.50) | PTGS2KCNA5CYP2A6ALDH1A1CYP3A4 | |
| SCHEMBL8479916 | 0.80 | PTGS2 (0.58) | AKR1C3AKR1C2PTGS2MMP1MMP2 | |
| SCHEMBL11075123 | 0.76 | PTGS2 (0.44) | AKR1C3AKR1C2PTGS2KCNA5MKNK1 | |
| SCHEMBL28755926 | 0.76 | PTGS2 (0.51) | AKR1C3AKR1C2PTGS2MMP1MMP2 | |
| SCHEMBL8148942 | 0.76 | PTGS2 (0.51) | AKR1C3AKR1C2PTGS2MMP1MMP2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100341880-C | Boric acid and boric acid ester compound ,their preparing method and use in pharmacy | SHANGHAI YAHU PHARMACEUTICAL C (CN) | 2007-10-10 | — | — | CN | claimed |
| CN-1521171-A | Boric acid and boric acid ester compound ,their preparing method and use in pharmacy | 上海雅虎制药股份有限公司 | 2004-08-18 | — | — | CN | claimed |
| CN-100341880-C | Boric acid and boric acid ester compound ,their preparing method and use in pharmacy | SHANGHAI YAHU PHARMACEUTICAL C (CN) | 2007-10-10 | — | — | CN | disclosed |
| CN-1521171-A | Boric acid and boric acid ester compound ,their preparing method and use in pharmacy | 上海雅虎制药股份有限公司 | 2004-08-18 | — | — | CN | disclosed |